CID 154723489

C28H32O2Si2Zn — CID 154723489

IUPAC—
SMILESC[Si](C)c1ccccc1.C[Si](C)c1ccccc1.Oc1ccccc1-c1ccccc1O.[Zn]
InChIInChI=1S/C12H10O2.2C8H11Si.Zn/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14;2*1-9(2)8-6-4-3-5-7-8;/h1-8,13-14H;2*3-7H,1-2H3;
InChIKeyFEZKYXBPAPXPEU-UHFFFAOYSA-N
MW522.12 g/mol
LogP6.06
Rot. Bonds3

About CID 154723489

CID 154723489 (PubChem CID 154723489) has the molecular formula C28H32O2Si2Zn and a molecular weight of 522.12 g/mol.

Molecular Properties

Compound NameCID 154723489
PubChem CID154723489
Molecular FormulaC28H32O2Si2Zn
Molecular Weight522.12 g/mol
Exact Mass520.12
IUPAC Name—
SMILESC[Si](C)c1ccccc1.C[Si](C)c1ccccc1.Oc1ccccc1-c1ccccc1O.[Zn]
InChIInChI=1S/C12H10O2.2C8H11Si.Zn/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14;2*1-9(2)8-6-4-3-5-7-8;/h1-8,13-14H;2*3-7H,1-2H3;
InChIKeyFEZKYXBPAPXPEU-UHFFFAOYSA-N
XLogP6.06
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500522.12
LogP ≤ 56.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze CID 154723489 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 154723489?
The IUPAC name of CID 154723489 (CID 154723489) is not available.
What is the SMILES notation for CID 154723489?
The canonical SMILES for CID 154723489 is C[Si](C)c1ccccc1.C[Si](C)c1ccccc1.Oc1ccccc1-c1ccccc1O.[Zn].
What is the InChIKey of CID 154723489?
The InChIKey is FEZKYXBPAPXPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O2.2C8H11Si.Zn/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14;2*1-9(2)8-6-4-3-5-7-8;/h1-8,13-14H;2*3-7H,1-2H3;.
What are the key properties of CID 154723489?
CID 154723489 has a molecular weight of 522.12 g/mol, XLogP of 6.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 154723489 is sourced from PubChem (CID 154723489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).